Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.37 |
| ▸ | TNF | P01375 | 1/20 | 0.35 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21915184 | 0.95 | TNF (0.38) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915329 | 0.88 | MAPT (0.48) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915196 | 0.87 | HSD17B1 (0.41) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915463 | 0.82 | HSD17B1 (0.36) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915506 | 0.82 | HDAC6 (0.39) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915416 | 0.81 | HDAC6 (0.41) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL17640569 | 0.81 | CYP19A1 (0.51) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915219 | 0.81 | HDAC6 (0.37) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915375 | 0.81 | CYP19A1 (0.39) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL17640631 | 0.80 | CYP19A1 (0.50) | HSD17B1HSD17B2MAPTSNCACYP19A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020062375-A1 | 1,2,4-THIADIAZOLE COMPOUNDS AND PREPARATION METHOD THEREFOR AND USE THEREOF | 武汉尚赛光电科技有限公司 | 2020-04-02 | — | — | WO | disclosed |